N,N'-(2,5-dimethyl-1,4-phenylene)bis[3-oxobutyramide]
TL;DR: N,N'-(2,5-dimethyl-1,4-phenylene)bis[3-oxobutyramide] (CAS 24304-50-5) is a chemical compound with molecular formula C16H20N2O4 and molecular weight 304.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2,5-dimethyl-4-(3-oxobutanoylamino)phenyl]-3-oxobutanamide
Also Known As: n,n'-(2,5-dimethyl-1,4-phenylene)bis(3-oxobutanamide), N,N'-(2,5-Dimethyl-1,4-phenylene)bis(3-oxobutyramide), N-[2,5-dimethyl-4-(3-oxobutanoylamino)phenyl]-3-oxobutanamide, EC 246-141-3, 2,5-BIS(ACETOACETAMIDO)-1,4-XYLENE
| Molecular Formula | C16H20N2O4 |
|---|---|
| Molecular Weight | 304.14 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 92.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 304.1423 |
| Heavy Atoms | 22 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 24304-50-5 |
|---|---|
| SMILES | CC1=CC(=C(C=C1NC(=O)CC(=O)C)C)NC(=O)CC(=O)C |
| InChIKey | NPISXGVUUHHCHZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N'-(2,5-dimethyl-1,4-phenylene)bis[3-oxobutyramide] (CAS 24304-50-5), with molecular formula C16H20N2O4 and molecular weight 304.14 g/mol. IUPAC: N-[2,5-dimethyl-4-(3-oxobutanoylamino)phenyl]-3-oxobutanamide.
Chemical Property Profile of N,N'-(2,5-dimethyl-1,4-phenylene)bis[3-oxobutyramide]
Property Insights of N,N'-(2,5-dimethyl-1,4-phenylene)bis[3-oxobutyramide]
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N'-(2,5-dimethyl-1,4-phenylene)bis[3-oxobutyramide]. The TPSA of 92.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N'-(2,5-dimethyl-1,4-phenylene)bis[3-oxobutyramide]. Following Lipinski's Rule of Five, N,N'-(2,5-dimethyl-1,4-phenylene)bis[3-oxobutyramide] has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,N'-(2,5-dimethyl-1,4-phenylene)bis[3-oxobutyramide]?
The CAS number of N,N'-(2,5-dimethyl-1,4-phenylene)bis[3-oxobutyramide] is 24304-50-5.
What is the molecular formula of N,N'-(2,5-dimethyl-1,4-phenylene)bis[3-oxobutyramide]?
The molecular formula of N,N'-(2,5-dimethyl-1,4-phenylene)bis[3-oxobutyramide] is C16H20N2O4.
What is the molecular weight of N,N'-(2,5-dimethyl-1,4-phenylene)bis[3-oxobutyramide]?
The molecular weight of N,N'-(2,5-dimethyl-1,4-phenylene)bis[3-oxobutyramide] is 304.14 g/mol.
Where can I buy N,N'-(2,5-dimethyl-1,4-phenylene)bis[3-oxobutyramide]?
You can request a quote for N,N'-(2,5-dimethyl-1,4-phenylene)bis[3-oxobutyramide] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-(2,5-dimethyl-1,4-phenylene)bis[3-oxobutyramide]?
Yes, KEHONG BIO provides custom synthesis services for N,N'-(2,5-dimethyl-1,4-phenylene)bis[3-oxobutyramide] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.